methyl 4-[4-[1-[(4-bromophenyl)sulfonylamino]-2-phenyl-ethyl]phenyl]butanoate

Systemtic Name: methyl 4-[4-[1-[(4-bromophenyl)sulfonylamino]-2-phenyl-ethyl]phenyl]butanoate Openeye Name: methyl 4-[4-[1-[(4-bromophenyl)sulfonylamino]-2-phenyl-ethyl]phenyl]butanoate CAS Name: 4-[4-[1-[(4-bromophenyl)sulfonylamino]-2-phenylethyl]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[1-[(4-bromophenyl)sulfonylamino]-2-phenylethyl]phenyl]butanoate Traditional Name: 4-[4-[1-(brosylamino)-2-phenyl-ethyl]phenyl]butyric acid methyl ester Formula: C25H26BrNO4S MolecularWeight: 516.44724

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=CC=C(C=C1)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC(=O)CCCC1=CC=C(C=C1)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C25H26BrNO4S/c1-31-25(28)9-5-8-19-10-12-21(13-11-19)24(18-20-6-3-2-4-7-20)27-32(29,30)23-16-14-22(26)15-17-23/h2-4,6-7,10-17,24,27H,5,8-9,18H2,1H3